F833-0506 Screening compound: N~1~-(2,5-difluorophenyl)-2-[9-(4-fluorophenyl)-3-oxopyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-2(3H)-yl]acetamide

F833-0506 Screening compound: N~1~-(2,5-difluorophenyl)-2-[9-(4-fluorophenyl)-3-oxopyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-2(3H)-yl]acetamide
F833-0506 Screening compound: N~1~-(2,5-difluorophenyl)-2-[9-(4-fluorophenyl)-3-oxopyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-2(3H)-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F833-0506
N~1~-(2,5-difluorophenyl)-2-[9-(4-fluorophenyl)-3-oxopyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-2(3H)-yl]acetamide

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

F833-0506

Molecular Formula

C21H13F3N6O2 (C21 H13 F3 N6 O2)

Compound Name

N~1~-(2,5-difluorophenyl)-2-[9-(4-fluorophenyl)-3-oxopyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-2(3H)-yl]acetamide

IUPAC name

N-(25-difluorophenyl)-2-[11-(4-fluorophenyl)-5-oxo-346910-pentaazatricyclo[7.3.0.0^{26}]dodeca-1(12)2710-tetraen-4-yl]acetamide

SMILES

O=C(CN1N=C(c2cc(-c(cc3)ccc3F)nn2C=C2)N2C1=O)Nc(cc(cc1)F)c1F

InChI

InChI=1S/C21H13F3N6O2/c22-13-3-1-12(2-4-13)16-10-18-20-27-30(21(32)28(20)7-8-29(18)26-16)11-19(31)25-17-9-14(23)5-6-15(17)24/h1-10H,11H2,(H,25,31)

InChI Key

GQWNJGZLILBOIO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27197533

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

438.37

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.974

Distribution Coefficient, logD

2.972

Water Solubility, LogSw

-3.24

Polar Surface Area

65.771

Acid Dissociation Constant (pKa)

9.57

Base Dissociation Constant (pKb)

-1.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.80

F833-0506 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
Agro:
  • Agro

References: we are preparing a list of scientific research reports with F833-0506 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F833-0506?
Check Price and Availability of F833-0506, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of F833-0506 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F833-0506
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F833-0506
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of F833-0506 available by request